(1-azanyl-1-phosphonato-ethyl)-oxidanyl-phosphinate; technetium(7+); tin(4+)

Systemtic Name: (1-azanyl-1-phosphonato-ethyl)-oxidanyl-phosphinate; technetium(7+); tin(4+) Openeye Name: tristannic; (1-amino-1-phosphonato-ethyl)-hydroxy-phosphinate; technetium(7+) CAS Name: (1-amino-1-phosphonatoethyl)-hydroxyphosphinate; technetium(7+); tin(4+) IUPAC Name: (1-amino-1-phosphonatoethyl)-hydroxyphosphinate; technetium(7+); tin(4+) Traditional Name: tristannic; (1-amino-1-phosphonato-ethyl)-hydroxy-phosphinate; technetium(7+) Formula: C22H66N11O66P22Sn3Tc3 MolecularWeight: 2872.06793

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Descriptors Computed from Structure

Canonical SMILES:

CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].[Tc+7].[Tc+7].[Tc+7].[Sn+4].[Sn+4].[Sn+4]

Isomeric SMILES

CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].CC(N)(P(=O)(O)[O-])P(=O)([O-])[O-].[Tc+7].[Tc+7].[Tc+7].[Sn+4].[Sn+4].[Sn+4]

InChI

InChI=1S/11C2H9NO6P2.3Sn.3Tc/c11*1-2(3,10(4,5)6)11(7,8)9;;;;;;/h11*3H2,1H3,(H2,4,5,6)(H2,7,8,9);;;;;;/q;;;;;;;;;;;3*+4;3*+7/p-33